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Hexanoic acid, 2-acetyl-3-methyl-4-oxo-, methyl ester
SpectraBase Compound ID DTMpTq1so4w
InChI InChI=1S/C10H16O4/c1-5-8(12)6(2)9(7(3)11)10(13)14-4/h6,9H,5H2,1-4H3
InChIKey VKLXOBJHZDEMBB-UHFFFAOYSA-N
Mol Weight 200.23 g/mol
Molecular Formula C10H16O4
Exact Mass 200.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fgzc5CAF1Cp
Name Hexanoic acid, 2-acetyl-3-methyl-4-oxo-, methyl ester
CAS Registry Number 71041-27-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O4
InChI InChI=1S/C10H16O4/c1-5-8(12)6(2)9(7(3)11)10(13)14-4/h6,9H,5H2,1-4H3
InChIKey VKLXOBJHZDEMBB-UHFFFAOYSA-N
Molecular Weight 200.234 g/mol
SMILES C(C(=O)OC)(C(C(=O)CC)C)C(=O)C
SPLASH splash10-0pbc-9500000000-29334882ad0eb786390f
Source of Spectrum J-44-3523-0
Synonyms Methyl .alpha.-(1-methyl-2-oxobutyl)acetoacetate Methyl 2-acetyl-3-methyl-4-oxohexanoate
Wiley ID 1197386